AG33038
541539-79-1 | 5-(Trifluoromethyl)-2,1,3-benzoxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AG33038
ChemicalName
5-(Trifluoromethyl)-2,1,3-benzoxadiazole
CasNumber
541539-79-1
MolecularFormula
C7H3F3N2O
MolecularWeight
188.1067
MdlNumber
MFCD03094538
Smiles
FC(c1ccc2c(c1)non2)(F)F
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
Xlogp3
2.1
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CatalogNumber: AG33038
ChemicalName: 5-(Trifluoromethyl)-2,1,3-benzoxadiazole
CasNumber: 541539-79-1
MolecularFormula: C7H3F3N2O
MolecularWeight: 188.1067
MdlNumber: MFCD03094538
Smiles: FC(c1ccc2c(c1)non2)(F)F
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
Xlogp3: 2.1
CatalogNumber:
AG33038
ChemicalName:
5-(Trifluoromethyl)-2,1,3-benzoxadiazole
CasNumber:
541539-79-1
MolecularFormula:
C7H3F3N2O
MolecularWeight:
188.1067
MdlNumber:
MFCD03094538
Smiles:
FC(c1ccc2c(c1)non2)(F)F
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
Xlogp3:
2.1
CatalogNumber: AG33039
ChemicalName: Methyl 3-amino-4-(butylamino)benzoate
CasNumber: 475489-75-9
MolecularFormula: C12H18N2O2
MolecularWeight: 222.2835
MdlNumber: MFCD14621909
Smiles: CCCCNc1ccc(cc1N)C(=O)OC
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
Xlogp3: 2.3
CatalogNumber:
AG33039
ChemicalName:
Methyl 3-amino-4-(butylamino)benzoate
CasNumber:
475489-75-9
MolecularFormula:
C12H18N2O2
MolecularWeight:
222.2835
MdlNumber:
MFCD14621909
Smiles:
CCCCNc1ccc(cc1N)C(=O)OC
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
Xlogp3:
2.3
CatalogNumber: AG33040
ChemicalName: 1-(Methylamino)cyclopentane-1-carbonitrile
CasNumber: 55793-49-2
MolecularFormula: C7H12N2
MolecularWeight: 124.1836
MdlNumber: MFCD00040167
Smiles: CNC1(CCCC1)C#N
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
Xlogp3: 0.6
CatalogNumber:
AG33040
ChemicalName:
1-(Methylamino)cyclopentane-1-carbonitrile
CasNumber:
55793-49-2
MolecularFormula:
C7H12N2
MolecularWeight:
124.1836
MdlNumber:
MFCD00040167
Smiles:
CNC1(CCCC1)C#N
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
Xlogp3:
0.6
CatalogNumber: AG33041
ChemicalName: Methyl 3-amino-4-(cyclopentylamino)benzoate
CasNumber: 448190-81-6
MolecularFormula: C13H18N2O2
MolecularWeight: 234.2942
MdlNumber: MFCD13343641
Smiles: COC(=O)c1ccc(c(c1)N)NC1CCCC1
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
Xlogp3: 2.3
CatalogNumber:
AG33041
ChemicalName:
Methyl 3-amino-4-(cyclopentylamino)benzoate
CasNumber:
448190-81-6
MolecularFormula:
C13H18N2O2
MolecularWeight:
234.2942
MdlNumber:
MFCD13343641
Smiles:
COC(=O)c1ccc(c(c1)N)NC1CCCC1
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
Xlogp3:
2.3